(E)-N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-3-(furan-2-yl)prop-2-enamide

Systemtic Name: (E)-N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-3-(furan-2-yl)prop-2-enamide Openeye Name: (E)-N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-3-(2-furyl)prop-2-enamide CAS Name: (E)-N-[3-(1-azepanylsulfonyl)-4-methylphenyl]-3-(2-furanyl)-2-propenamide IUPAC Name: (E)-N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]-3-(furan-2-yl)prop-2-enamide Traditional Name: (E)-N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-3-(2-furyl)acrylamide Formula: C20H24N2O4S MolecularWeight: 388.48056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C=CC2=CC=CO2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)/C=C/C2=CC=CO2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C20H24N2O4S/c1-16-8-9-17(21-20(23)11-10-18-7-6-14-26-18)15-19(16)27(24,25)22-12-4-2-3-5-13-22/h6-11,14-15H,2-5,12-13H2,1H3,(H,21,23)/b11-10+